(phenylmethyl) N-[1-(2-cyano-1,2-diazinan-1-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(2-cyano-1,2-diazinan-1-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-(2-cyanohexahydropyridazine-1-carbonyl)-2-methyl-butyl]carbamate CAS Name: N-[1-(2-cyano-1-diazinanyl)-3-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(2-cyanodiazinan-1-yl)-3-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-(2-cyanohexahydropyridazine-1-carbonyl)-2-methyl-butyl]carbamic acid benzyl ester Formula: C19H26N4O3 MolecularWeight: 358.43474

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCCN1C#N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)N1CCCCN1C#N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H26N4O3/c1-3-15(2)17(18(24)23-12-8-7-11-22(23)14-20)21-19(25)26-13-16-9-5-4-6-10-16/h4-6,9-10,15,17H,3,7-8,11-13H2,1-2H3,(H,21,25)